| Properties | Image |
|---|
| MNX_ID | MNXM1196835 |
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| reference | envipathM:...bdec67c54250 |
| formula | C32H41F17O7 |
| global charge | -2 |
| mol weight | 860.639 |
| InChIKey | DNCDMSSMUGADRP-UHFFFAOYSA-L |
| InChI | InChI=1S/C32H43F17O7/c33-25(34,26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)31(45,46)32(47,48)49)16-17-56-22(51)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-20(19-50)18-21(23(52)53)24(54)55/h20-21,50H,1-19H2,(H,52,53)(H,54,55)/p-2 |
| SMILES | O=C(CCCCCCCCCCCCCCCC(CO)CC(C(=O)[O-])C(=O)[O-])OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
MNX internals
| InChI (mnx) | InChI=1/C32H43F17O7/c33-25(34,26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)31(45,46)32(47,48)49)16-17-56-22(51)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-20(19-50)18-21(23(52)53)24(54)55/h20-21,50H,1-19H2,(H,52,53)(H,54,55)/t20? |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH:20]([CH2:18][CH:21]([C:23](=[O:52])[OH:53])[C:24](=[O:54])[OH:55])[CH2:19][OH:50])[CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][C:22](=[O:51])[O:56][CH2:17][CH2:16][C:25]([C:26]([C:27]([C:28]([C:29]([C:30]([C:31]([C:32]([F:47])([F:48])[F:49])([F:45])[F:46])([F:43])[F:44])([F:41])[F:42])([F:39])[F:40])([F:37])[F:38])([F:35])[F:36])([F:33])[F:34] |
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